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3,3a-Epoxy-4-hydroxymethylverticillene
SpectraBase Compound ID GtgsUzNDhv
InChI InChI=1S/C21H34O2/c1-15-7-6-8-16(2)13-18(14-22)21-19(3,4)17(10-9-15)11-12-20(21,5)23-21/h8-9,17-18,22H,6-7,10-14H2,1-5H3/b15-9+,16-8+/t17-,18+,20-,21+/m0/s1
InChIKey FNPDBDIMRRKSRE-YFPFAYPGSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CAVnHojdGfO
Name 3,3a-Epoxy-4-hydroxymethylverticillene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-15-7-6-8-16(2)13-18(14-22)21-19(3,4)17(10-9-15)11-12-20(21,5)23-21/h8-9,17-18,22H,6-7,10-14H2,1-5H3/b15-9+,16-8+/t17-,18+,20-,21+/m0/s1
InChIKey FNPDBDIMRRKSRE-YFPFAYPGSA-N
Molecular Weight 318.501 g/mol
SMILES OC[C@@]1([C@@]23[C@@](CC[C@@](C3(C)C)(C\C=C/(C)CC\C=C\(C1)C)[H])(C)O2)[H]
SPLASH splash10-0f79-0930000000-67e43100a01006375e4e
Source of Spectrum AJ-69-226-15
Synonyms [(1R,2R,11R,14S)-4,8,14,16,16-pentamethyl-15-oxatricyclo[9.4.1.0(1,14)]hexadeca-4,8-dien-2-yl]methanol
Wiley ID 773626